⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10938938 | 0.90 | MAPK1 (0.42) | — | |
| SCHEMBL8310482 | 0.84 | — | — | |
| SCHEMBL8327575 | 0.84 | KDM4E (0.46) | — | |
| SCHEMBL6223853 | 0.81 | ALDH1A1 (0.46) | — | |
| SCHEMBL11119 | 0.81 | — | — | |
| SCHEMBL8310094 | 0.80 | — | — | |
| Fluoride SCHEMBL25246136 | 0.78 | KDM4E (0.42) | — | |
| SCHEMBL3631301 | 0.78 | KDM4E (0.42) | — | |
| Hydrochloric Acid SCHEMBL2532416 | 0.78 | L3MBTL1 (0.43) | — | |
| Iodide SCHEMBL1835511 | 0.78 | KDM4E (0.42) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0790986-B1 | ANILINE DERIVATIVES | ZENECA LTD (GB) | 1999-01-20 | — | — | EP | disclosed |
| US-5821246-A | USEFUL AS TYROSINE KINASE INHIBITORS AND FOR THE TREATMENT OF PROLIFERATIVE DISEASES SUCH AS CANCER | ZENECA LIMITED (GB) | 1998-10-13 | — | — | US | disclosed |
| EP-0790986-A1 | ANILINE DERIVATIVES | ZENECA LIMITED (GB) | 1997-08-27 | — | — | EP | disclosed |
| WO-1996015118-A1 | ANILINE DERIVATIVES | ZENECA LIMITED (GB) | 1996-05-23 | — | — | WO | disclosed |